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Propanedinitrile, ((2,6-dibromo-4-fluorophenyl)hydrazono)-

HCID 3049415
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Basic information

CAS
64691-96-9
Standard SMILES
N#CC(C#N)=NNc1c(Br)cc(F)cc1Br
InChIKey
CCPDPCQUJJAYCT-UHFFFAOYSA-N
Molecular formula
C9H3Br2FN4
Average molar mass
345.95 g/mol
Monoisotopic mass
343.87085

Names & identifiers

Preferred name
Propanedinitrile, ((2,6-dibromo-4-fluorophenyl)hydrazono)-
IUPAC
2-[(2,6-dibromo-4-fluorophenyl)hydrazinylidene]propanedinitrile

Names & synonyms

BRN 1822043Propanedinitrile, ((2,6-dibromo-4-fluorophenyl)hydrazono)-64691-96-9((2,6-Dibromo-4-fluorophenyl)hydrazono)propanedinitrileMesoxalonitrile, (2,6-dibromo-4-fluorophenyl)hydrazoneDTXSID90215005RefChem:374361DTXCID50137496(2,6-Dibromo-4-fluorophenyl)carbonohydrazonoyl dicyanide

Database identifiers

CAS
64691-96-9
PubChem CID
3049415
DTXSID
DTXSID90215005

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
72 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Formal charge
0
Complexity
349

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Compound notes

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